(NZ)-N-[(10Z)-10-(benzenesulfonylimino)-3-tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraenylidene]benzenesulfonamide
Formula:C27H22N2O4S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(10Z)-10-(benzenesulfonylimino)-3-tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraenylidene]benzenesulfonamide is not a drug-like molecule.
| MolName | (NZ)-N-[(10Z)-10-(benzenesulfonylimino)-3-tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraenylidene]benzenesulfonamide |
| MolecularFormula | C27H22N2O4S2 |
| Smiles | O=S(c1ccccc1)(/N=C(/C1C2C3C=CC1C3)\c(cccc1)c1/C2=N\S(c1ccccc1)(=O)=O)=O |
| InChI | InChI=1S/C27H22N2O4S2/c30-34(31,20-9-3-1-4-10-20)28-26-22-13-7-8-14-23(22)27(25-19-16-15-18(17-19)24(25)26)29-35(32,33)21-11-5-2-6-12-21/h1-16,18-19,24-25H,17H2 |
| InChIK | GRMYLPFDWSZQBP-UHFFFAOYSA-N |
| TotalMolweight | 502.614 |
| Molweight | 502.614 |
| MonoisotopicMass | 502.102098 |
| CLogP | 4.6774 |
| CLogS | -6.108 |
| H Acceptors | 6 |
| TotalSurfaceArea | 345.64 |
| Relative PSA | 0.23198 |
| PolarSurfaceArea | 109.76 |
| Druglikeness | -6.5216 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.45714 |
| Fragments | 1 |
| Non HAtoms | 35 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| StereoCenters | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 6 |
| Small Rings | 7 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 7 |
| Symmetricatoms | 20 |
| BasicNitrogens | 2 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - (NZ)-N-[(10Z)-10-(benzenesulfonylimino)-3-tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraenylidene]benzenesulfonamide | 2 - (NZ)-N-[(10Z)-10-(benzenesulfonylimino)-3-tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraenylidene]benzenesulfonamide
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